Vitas-M small molecule compound
(E)-{2-(3,4-diethoxyphenyl)-1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxopyrrolidin-3-ylidene}(thiophen-2-yl)methanolate
Catalog ID
STL037168
SMILES CCOc1cc(ccc1OCC)C1/C(=C(/c2cccs2)\[O-])/C(=O)C(=O)N1CC[NH+]1CCOCC1
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C25H30N2O6S MW 486.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H30N2O6S/c1-3-32-18-8-7-17(16-19(18)33-4-2)22-21(23(28)20-6-5-15-34-20)24(29)25(30)27(22)10-9-26-11-13-31-14-12-26/h5-8,15-16,22,28H,3-4,9-14H2,1-2H3/b23-21+InChIKey
CFVKCNODAQDKAR-XTQSDGFTSA-NSynonyms
(E)(2(34diethoxyphenyl)1(2(morpholin4ium4yl)ethyl)45dioxopyrrolidin3ylidene)(thiophen2yl)methanolate
CCOc1cc(ccc1OCC)C1C(=C(c2cccs2)(O))C(=O)C(=O)N1CC(NH+)1CCOCC1
MFCD18247375
ZINC000008905055
ZINC000102857385
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